Ensuring N-representability: Coleman's algorithm

Chemical Physics Letters

Volumn 355, Issue 3-4, 2002, Pages 263-269

  Beste, A ^a   Runge, K ^a   Bartlett, R ^a  

^a UNIVERSITY OF FLORIDA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALGORITHM; ARTICLE; DENSITY; ENERGY; MATHEMATICAL COMPUTING;

EID: 0011169664     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(02)00239-7     Document Type: Article

References (28)

1. Coleman A.J., Yukalov V.I. Reduced Density Matrices: Coulson's Challenge. 2000;Springer, New York.
2. Balint I., Dezso G., Gyemant I. J. Mol. Struct. (Theochem). 501-502:2000;125.
3. Dezso G., Balint I., Gyemant I. J. Mol. Struct. (Theochem). 542:2001;21.
4. Balint I., Dezso G., Gyemant I. J. Chem. Inf. Comput. Sci. 41:2001;806.
5. Balint I., Dezso G., Gyemant I. Int. J. Quantum Chem. 84:2001;32.
6. Lanczos C. J. Res. Nat. Bur. Stand. 45:1950;255.
7. Nesbet R.K. J. Chem. Phys. 43:1965;311.
8. Bartlett R.J., Brandas E.J. J. Chem. Phys. 56:1972;5467.
9. Davidson E.R. J. Comput. Phys. 17:1975;87.
10. Cohen L., Frishberg C. Phys. Rev. A. 13:1976;927.
11. Nakatsuji H. Phys. Rev. A. 14:1976;41.
12. Valdemoro C. Phys. Rev. A. 45:1992;4462.
13. Colmenero F., Perez del Valle C., Valdemoro C. Phys. Rev. A. 47:1993;971.
14. Colmenero F., Valdemoro C. Phys. Rev. A. 47:1993;979.
15. Colmenero F., Valdemoro C. Int. J. Quantum Chem. 51:1994;369.
16. Valdemoro C., Tel L.M., Perez-Romero E. Adv. Quantum Chem. 28:1997;33.
17. Valdemoro C., de Lara-Castells M.P., Perez-Romero E., Tel L.M. Adv. Quantum Chem. 31:1999;37.
18. Valdemoro C., Tel L.M., Perez-Romero E. Phys. Rev. A. 61:2000;2507.
19. Valdemoro C., Tel L.M., Perez-Romero E., Torre A. J. Mol. Struct. (Theochem.). 537:2001;1.
20. Tel L.M., Perez-Romero E., Valdemoro C., Casquero F.J. Int. J. Quantum Chem. 82:2001;131.
21. Nakatsuji H., Yasuda K. Phys. Rev. Lett. 76:1996;1039.
22. Yasuda K., Nakatsuji H. Phys. Rev. A. 56:1997;2648.
23. Ehara M., Nakata M., Kou H., Yasuda K., Nakatsuji H. Chem. Phys. Lett. 305:1999;483.
24. Nakata M., Ehara M., Yasuda K., Nakatsuji H. J. Chem. Phys. 112:2000;8772.
25. Nakatsuji H. Theor. Chem. Acc. 102:1999;97.
26. Mazziotti D.A. Chem. Phys. Lett. 289:1998;419.
27. Mazziotti D.A. Phys. Rev. A. 57:1998;4219.
28. Mazziotti D.A. Phys. Rev. A. 60:1999;3618.